3-methyl-2-(6,7,8,9-tetrahydrodibenzofuran-3-ylsulfanylamino)butanoic acid

Systemtic Name: 3-methyl-2-(6,7,8,9-tetrahydrodibenzofuran-3-ylsulfanylamino)butanoic acid Openeye Name: 3-methyl-2-(6,7,8,9-tetrahydrodibenzofuran-3-ylsulfanylamino)butanoic acid CAS Name: 3-methyl-2-[(6,7,8,9-tetrahydrodibenzofuran-3-ylthio)amino]butanoic acid IUPAC Name: 3-methyl-2-(6,7,8,9-tetrahydrodibenzofuran-3-ylsulfanylamino)butanoic acid Traditional Name: 3-methyl-2-[(6,7,8,9-tetrahydrodibenzofuran-3-ylthio)amino]butyric acid Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NSC1=CC2=C(C=C1)C3=C(O2)CCCC3

Isomeric SMILES

CC(C)C(C(=O)O)NSC1=CC2=C(C=C1)C3=C(O2)CCCC3

InChI

InChI=1S/C17H21NO3S/c1-10(2)16(17(19)20)18-22-11-7-8-13-12-5-3-4-6-14(12)21-15(13)9-11/h7-10,16,18H,3-6H2,1-2H3,(H,19,20)